3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one

C8H12N4O — CID 83875433

IUPAC3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one
SMILESNCc1cnc2n(c1=O)CCNC2
InChIInChI=1S/C8H12N4O/c9-3-6-4-11-7-5-10-1-2-12(7)8(6)13/h4,10H,1-3,5,9H2
InChIKeyMIWVYXWNEHNPLQ-UHFFFAOYSA-N
MW180.21 g/mol
LogP-1.19
Rot. Bonds1

About 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one

3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one (PubChem CID 83875433) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one
PubChem CID83875433
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one
SMILESNCc1cnc2n(c1=O)CCNC2
InChIInChI=1S/C8H12N4O/c9-3-6-4-11-7-5-10-1-2-12(7)8(6)13/h4,10H,1-3,5,9H2
InChIKeyMIWVYXWNEHNPLQ-UHFFFAOYSA-N
XLogP-1.19
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-Methyl-1-(1,4,5,6-tetrahydropyrimidin-2-ylmethyl)pyrimidine-2,4-dione
CID 394413
2-[3-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methylamino]propyl]guanidine
CID 66581406
6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine-3-carboxamide
CID 156102762
5-Iodo-2-methyl-3-(3-oxo-3-piperazin-1-ylpropyl)pyrimidin-4-one
CID 66340706
N-ethyl-2-{4-[(2-methyl-6-oxo-1,6-dihydro-5-pyrimidinyl)carbonyl]-1-piperazinyl}acetamide
CID 72909858
N-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methyl]acetamide
CID 76852062
5-(piperazin-1-ylmethyl)-1H-pyrimidin-6-one
CID 82505249
5-(piperazine-1-carbonyl)-1H-pyrimidin-6-one
CID 82507534
2-methyl-5-(piperazin-1-ylmethyl)-1H-pyrimidin-6-one
CID 82507622
2-amino-5-(piperazin-1-ylmethyl)-1H-pyrimidin-6-one
CID 82507832
2-methyl-5-(piperazine-1-carbonyl)-1H-pyrimidin-6-one
CID 82509423
2-ethyl-5-(piperazin-1-ylmethyl)-1H-pyrimidin-6-one
CID 82509438

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one?
The IUPAC name of 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one (CID 83875433) is 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one?
The canonical SMILES for 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one is NCc1cnc2n(c1=O)CCNC2.
What is the InChIKey of 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one?
The InChIKey is MIWVYXWNEHNPLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c9-3-6-4-11-7-5-10-1-2-12(7)8(6)13/h4,10H,1-3,5,9H2.
What are the key properties of 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one?
3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one has a molecular weight of 180.21 g/mol, XLogP of -1.19, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-6,7,8,9-tetrahydropyrazino[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 83875433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).